General Information of the Compound
| Compound ID |
CP0069658
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| Compound Name |
2-Thioxanthine, TX4
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| Synonyms |
(R)-3-((Tetrahydrofuran-2-yl)methyl)-2-thioxo-1,2,3,7-tetrahydro-6H-purin-6-one
2-Thioxanthine, TX4
3-(((2R)-Oxolan-2-yl)methyl)-2-sulfanylidene-7H-purin-6-one
3-[[(2R)-oxolan-2-yl]methyl]-2-sulfanylidene-7H-purin-6-one
618913-30-7
62A9CG81VN
6H-Purin-6-one, 1,2,3,7-tetrahydro-3-(((2R)-tetrahydro-2-furanyl)methyl)-2-thioxo-
6H-Purin-6-one, 1,2,3,9-tetrahydro-3-(((2R)-tetrahydro-2-furanyl)methyl)-2-thioxo-
AZD 5904
AZD-5904
AZD5904
BDBM92469
CS-0035112
GTPL7728
HY-111341
SCHEMBL2288062
TX-4
UNII-62A9CG81VN
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| Structure |
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| Formula |
C10H12N4O2S
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| Molecular Weight |
252.299
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| Canonical SMILES |
O=c1[nH]c(=S)n(C[C@H]2CCCO2)c2nc[nH]c12
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| InChI |
InChI=1S/C10H12N4O2S/c15-9-7-8(12-5-11-7)14(10(17)13-9)4-6-2-1-3-16-6/h5-6H,1-4H2,(H,11,12)(H,13,15,17)/t6-/m1/s1
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| InChIKey |
RSPDBEVKURKEII-ZCFIWIBFSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Clinical Information about the Compound